CID 235571

1-(2-methylphenyl)-3-phenylguanidine

Structural Information

Molecular Formula
C14H15N3
SMILES
CC1=CC=CC=C1N=C(N)NC2=CC=CC=C2
InChI
InChI=1S/C14H15N3/c1-11-7-5-6-10-13(11)17-14(15)16-12-8-3-2-4-9-12/h2-10H,1H3,(H3,15,16,17)
InChIKey
IKOWCCQMFQLCGP-UHFFFAOYSA-N
Compound name
2-(2-methylphenyl)-1-phenylguanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

86
Patents

225.1266 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.13388 153.1
[M+Na]+ 248.11582 165.5
[M+NH4]+ 243.16042 162.0
[M+K]+ 264.08976 157.7
[M-H]- 224.11932 159.8
[M+Na-2H]- 246.10127 163.1
[M]+ 225.12605 156.6
[M]- 225.12715 156.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe